Mrv0541 02241205262D          

  5  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Se  0  6  0  0  0  0  0  0  0  0  0  0
    1.1196    0.0000    0.0000 Se  0  6  0  0  0  0  0  0  0  0  0  0
    2.2393    0.0000    0.0000 Se  0  6  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 In  0  1  0  0  0  0  0  0  0  0  0  0
    1.1196   -1.6500    0.0000 In  0  1  0  0  0  0  0  0  0  0  0  0
M  CHG  5   1  -2   2  -2   3  -2   4   3   5   3
M  END
> <DATABASE_ID>
T3D1835

> <DATABASE_NAME>
t3db

> <SMILES>
[Se--].[Se--].[Se--].[In+3].[In+3]

> <INCHI_IDENTIFIER>
InChI=1S/2In.3Se/q2*+3;3*-2

> <INCHI_KEY>
AKUCEXGLFUSJCD-UHFFFAOYSA-N

> <FORMULA>
In2Se3

> <MOLECULAR_WEIGHT>
466.52

> <EXACT_MASS>
469.55732214

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
diindium(3+) ion triselandiide

> <JCHEM_LOGP>
-0.5047

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
13.1149

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
diindium(3+) ion triselandiide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1835

> <NAME>
Indium(III) selenide

> <CAS>
12056-07-4

> <SYNONYMS>
DIIndium triselenide; Indium selenide; Indium selenide (In2Se3)

> <TYPES>
Inorganic Compound; Selenium Compound; Pollutant; Industrial/Workplace Toxin; Synthetic Compound

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